3-azanyl-4-(4-chlorophenyl)sulfanyl-benzenecarbonitrile

Systemtic Name: 3-azanyl-4-(4-chlorophenyl)sulfanyl-benzenecarbonitrile Openeye Name: 3-amino-4-(4-chlorophenyl)sulfanyl-benzonitrile CAS Name: 3-amino-4-[(4-chlorophenyl)thio]benzonitrile IUPAC Name: 3-amino-4-(4-chlorophenyl)sulfanylbenzonitrile Traditional Name: 3-amino-4-[(4-chlorophenyl)thio]benzonitrile Formula: C13H9ClN2S MolecularWeight: 260.74196

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1SC2=C(C=C(C=C2)C#N)N)Cl

Isomeric SMILES

C1=CC(=CC=C1SC2=C(C=C(C=C2)C#N)N)Cl

InChI

InChI=1S/C13H9ClN2S/c14-10-2-4-11(5-3-10)17-13-6-1-9(8-15)7-12(13)16/h1-7H,16H2